%chk=000140628.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000140628

0 1
 O   -3.282800       2.551300     -0.3158000    
 O    1.299900       1.907700      -1.617900    
 O  -0.8449000       3.416400     -5.2600000E-02
 O   0.1611000      0.6274000       1.314800    
 C   -2.709000      0.2651000      2.0999999E-03
 C    2.446800      0.2965000     -0.2971000    
 C   -3.020400     -0.2852000       1.245400    
 C    2.405400      -1.016200     -0.7395000    
 C   -2.669900     -0.5479000      -1.130600    
 C    3.518000      0.7739000      0.4412000    
 C   -3.253900      -2.461900      0.2234000    
 C    4.547700      -1.407500      0.3066000    
 C   -3.292800      -1.648700       1.356000    
 C    3.462700      -1.873800     -0.4356000    
 C   -2.942500      -1.911400      -1.019900    
 C    4.575300     -8.3700001E-02  0.7451000    
 C   -2.424000       1.691600     -0.1137000    
 C    1.327100       1.204900     -0.6189000    
 C   -3.069700      0.5604000       2.476400    
 C    1.256900      -1.544500      -1.536200    
 C   -2.340000      1.2800000E-02  -2.475800    
 C    3.576300       2.186800      0.9243000    
 C   -1.019600       2.211700      3.5799999E-02
 C   0.1593000       1.318800      0.3088000    
 C   -3.545000      -3.919800      0.3417000    
 C    5.678100      -2.324600      0.6316000    
 H   -3.537700      -2.082500       2.322700    
 H    3.446300      -2.906600     -0.7760000    
 H   -2.914400      -2.549600      -1.900000    
 H    5.424300      0.2753000       1.322200    
 H   -2.092300       1.002500       2.689500    
 H   -3.810200       1.359200       2.363200    
 H   -3.359400     -2.2299999E-02   3.357900    
 H   0.3510000      -1.570200     -0.9231000    
 H    1.080400     -0.9261000      -2.422300    
 H    1.441900      -2.564400      -1.890700    
 H   -3.056400      0.7929000      -2.753600    
 H   -2.378100     -0.7539000      -3.257300    
 H   -1.328400      0.4308000      -2.481800    
 H    2.755600       2.388600       1.620400    
 H    4.511700       2.398300       1.454000    
 H    3.518400       2.884600      8.2400002E-02
 H   -3.253500      -4.303000       1.325400    
 H   -4.614600      -4.102200      0.1971000    
 H   -2.986500      -4.495900     -0.4040000    
 H    6.437100      -2.278700     -0.1556000    
 H    6.144600      -2.054800       1.585200    
 H    5.332700      -3.359700      0.7265000    


%chk=000140628-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000140628

0 1
O -1.353008 1.256511 1.795810
O 1.262289 -1.449491 -1.683979
O -0.135137 1.326357 -1.023056
O 0.487303 -1.241262 1.374982
C -2.984387 -0.012026 0.474068
C 3.196057 -0.644173 -0.410358
C -4.019241 0.072018 1.481604
C 4.166563 -1.477520 -1.076338
C -3.252053 -0.702049 -0.766419
C 3.633850 0.383825 0.498843
C -5.544112 -1.220883 0.021432
C 5.985165 -0.282699 0.105031
C -5.266832 -0.538370 1.228977
C 5.535620 -1.283228 -0.789182
C -4.521504 -1.289104 -0.955348
C 5.016425 0.540974 0.729687
C -1.668505 0.580994 0.755777
C 1.761723 -0.852116 -0.671245
C -3.837317 0.771807 2.814840
C 3.788713 -2.571858 -2.056912
C -2.257273 -0.822611 -1.909516
C 2.681535 1.347042 1.190338
C -0.416653 0.484304 -0.130635
C 0.642864 -0.539419 0.343954
C -6.903655 -1.840881 -0.232244
C 7.464124 -0.075492 0.365681
H -6.044578 -0.480991 2.000023
H 6.272321 -1.930589 -1.280097
H -4.720665 -1.816275 -1.896142
H 5.349524 1.330778 1.414020
H -2.978323 0.364609 3.377206
H -3.615821 1.845889 2.686659
H -4.750040 0.665350 3.426056
H 3.015048 -3.246879 -1.650144
H 3.355027 -2.149894 -2.980278
H 4.677492 -3.169676 -2.322187
H -1.982862 0.164278 -2.322154
H -2.696958 -1.417671 -2.727414
H -1.311184 -1.320485 -1.626262
H 2.070070 0.849166 1.963855
H 3.250813 2.146244 1.693881
H 1.992394 1.835112 0.478752
H -7.407275 -2.116248 0.710343
H -7.565181 -1.128044 -0.762662
H -6.825951 -2.744134 -0.862173
H 7.874680 0.703716 -0.306040
H 7.650228 0.256702 1.402018
H 8.041287 -0.999211 0.188647


